input word = C00048845

Metabolite InformationStructural formula
Name Robustolide K
Formula C26H33ClO10
Mw 540.17622499
CAS RN 1124328-13-7
C_ID C00048845 ,
InChIKey ZRZXIRDSOAIGOX-CIHGWTOFNA-N
InChICode InChI=1S/C26H33ClO10/c1-12-7-8-17(33-14(3)29)24(6)18(34-15(4)30)9-10-25(11-28)20(27)22-26(37-25,13(2)23(32)36-22)21(19(12)24)35-16(5)31/h9-10,13,17-22,28H,1,7-8,11H2,2-6H3/b10-9+/t13-,17-,18-,19+,20+,21-,22-,24+,25+,26+/m0/s1
SMILES [C@]12([C@H](/C=C/[C@]3([C@@H]([C@H]4[C@@]([C@H]([C@H]1C(=C)CC[C@@H]2OC(=O)C)OC(=O)C)(O3)[C@H](C(=O)O4)C)Cl)CO)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Ellisella robusta Ref.
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